N-[2-(3,4-dimethoxyphenyl)ethyl]thian-4-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]thian-4-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]tetrahydrothiopyran-4-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-thianamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]thian-4-amine Traditional Name: homoveratryl(tetrahydrothiopyran-4-yl)amine Formula: C15H23NO2S MolecularWeight: 281.41362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2CCSCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2CCSCC2)OC

InChI

InChI=1S/C15H23NO2S/c1-17-14-4-3-12(11-15(14)18-2)5-8-16-13-6-9-19-10-7-13/h3-4,11,13,16H,5-10H2,1-2H3